3-[(4-nitrophenyl)amino]propane-1,2-diol

Systemtic Name: 3-[(4-nitrophenyl)amino]propane-1,2-diol Openeye Name: 3-(4-nitroanilino)propane-1,2-diol CAS Name: 3-(4-nitroanilino)propane-1,2-diol IUPAC Name: 3-(4-nitroanilino)propane-1,2-diol Traditional Name: 3-(4-nitroanilino)propane-1,2-diol Formula: C9H12N2O4 MolecularWeight: 212.20258

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NCC(CO)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NCC(CO)O)[N+](=O)[O-]

InChI

InChI=1S/C9H12N2O4/c12-6-9(13)5-10-7-1-3-8(4-2-7)11(14)15/h1-4,9-10,12-13H,5-6H2